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(2S,3R,4R)-2-Methyl-4-((RS)-4-methylhexyl)-5-oxotetrahydrofuran-3-yl propionate
SpectraBase Compound ID GTcx7Baoh8L
InChI InChI=1S/C15H26O4/c1-5-10(3)8-7-9-12-14(19-13(16)6-2)11(4)18-15(12)17/h10-12,14H,5-9H2,1-4H3/t10?,11-,12+,14-/m0/s1
InChIKey DGWFLRKQTLOOKV-CMGMYYOESA-N
Mol Weight 270.37 g/mol
Molecular Formula C15H26O4
Exact Mass 270.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yCL5oZAPY
Name (2S,3R,4R)-2-Methyl-4-((RS)-4-methylhexyl)-5-oxotetrahydrofuran-3-yl propionate
Alternate Name(s) (2S,3R,4R)-2-methyl-4-(4-methylhexyl)-5-oxotetrahydrofuran-3-yl propionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O4
InChI InChI=1S/C15H26O4/c1-5-10(3)8-7-9-12-14(19-13(16)6-2)11(4)18-15(12)17/h10-12,14H,5-9H2,1-4H3/t10?,11-,12+,14-/m0/s1
InChIKey DGWFLRKQTLOOKV-CMGMYYOESA-N
Literature Reference DOI 10.1002/cbic.201200260
Molecular Weight 270.369 g/mol
SMILES C1(O[C@]([C@@]([C@]1(CCCC(CC)C)[H])(OC(CC)=O)[H])(C)[H])=O
SPLASH splash10-0a4k-9300000000-9b680f5d82fdb8ff91e6
Source of Spectrum CBC-13-1635/SM37-77
Wiley ID 1786773